(1Z,5Z)-3,4-dimethylcycloocta-1,5-diene

C10H16 — CID 5365753

IUPAC(1Z,5Z)-3,4-dimethylcycloocta-1,5-diene
SMILESCC1/C=C\CC/C=C\C1C
InChIInChI=1S/C10H16/c1-9-7-5-3-4-6-8-10(9)2/h5-10H,3-4H2,1-2H3/b7-5-,8-6-
InChIKeySAOXWIPRWNIEIH-SFECMWDFSA-N
MW136.24 g/mol
LogP3.16
Rot. Bonds

About (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene

(1Z,5Z)-3,4-dimethylcycloocta-1,5-diene (PubChem CID 5365753) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene.

Molecular Properties

Compound Name(1Z,5Z)-3,4-dimethylcycloocta-1,5-diene
PubChem CID5365753
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(1Z,5Z)-3,4-dimethylcycloocta-1,5-diene
SMILESCC1/C=C\CC/C=C\C1C
InChIInChI=1S/C10H16/c1-9-7-5-3-4-6-8-10(9)2/h5-10H,3-4H2,1-2H3/b7-5-,8-6-
InChIKeySAOXWIPRWNIEIH-SFECMWDFSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene?
The IUPAC name of (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene (CID 5365753) is (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene.
What is the SMILES notation for (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene?
The canonical SMILES for (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene is CC1/C=C\CC/C=C\C1C.
What is the InChIKey of (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene?
The InChIKey is SAOXWIPRWNIEIH-SFECMWDFSA-N. The full InChI is InChI=1S/C10H16/c1-9-7-5-3-4-6-8-10(9)2/h5-10H,3-4H2,1-2H3/b7-5-,8-6-.
What are the key properties of (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene?
(1Z,5Z)-3,4-dimethylcycloocta-1,5-diene has a molecular weight of 136.24 g/mol, XLogP of 3.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5Z)-3,4-dimethylcycloocta-1,5-diene is sourced from PubChem (CID 5365753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).